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	hartrees
Energy at 0K	-132.226428
Energy at 298.15K	-132.228555
HF Energy	-131.844748
Nuclear repulsion energy	59.357527

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3635	3358	17.06
2	A'	3586	3312	75.74
3	A'	2350	2171	66.93
4	A'	1737	1604	35.91
5	A'	1104	1020	9.84
6	A'	753	695	264.88
7	A'	517	477	86.16
8	A'	365	337	19.99
9	A"	3729	3444	27.74
10	A"	1271	1174	0.00
11	A"	663	613	41.49
12	A"	354	327	1.77

Atom	x (Å)	y (Å)	z (Å)
C1	-0.044	1.366	0.000
C2	0.000	0.165	0.000
N3	0.127	-1.194	0.000
H4	-0.117	2.425	0.000
H5	-0.255	-1.626	0.829
H6	-0.255	-1.626	-0.829

	C1	C2	N3	H4	H5	H6
C1		1.2013	2.5657	1.0618	3.1113	3.1113
C2	1.2013		1.3654	2.2628	1.9899	1.9899
N3	2.5657	1.3654		3.6275	1.0097	1.0097
H4	1.0618	2.2628	3.6275		4.1370	4.1370
H5	3.1113	1.9899	1.0097	4.1370		1.6579
H6	3.1113	1.9899	1.0097	4.1370	1.6579

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	176.751	C2	C1	H4	178.173
C2	N3	H5	112.966	C2	N3	H6	112.966
H5	N3	H6	110.359

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: CID/6-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for HCCNH2 (Ethynamine)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)